O4-ethyl O2-propan-2-yl 5-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-propan-2-yl 5-[(6-bromanyl-2-oxidanylidene-chromen-3-yl)carbonylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O4-ethyl O2-isopropyl 5-[(6-bromo-2-oxo-chromene-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[(6-bromo-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O4-ethyl ester O2-propan-2-yl ester IUPAC Name: 4-O-ethyl 2-O-propan-2-yl 5-[(6-bromo-2-oxochromene-3-carbonyl)amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[(6-bromo-2-keto-chromene-3-carbonyl)amino]-3-methyl-thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-isopropyl ester Formula: C22H20BrNO7S MolecularWeight: 522.3657

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OC(C)C)NC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C22H20BrNO7S/c1-5-29-21(27)16-11(4)17(22(28)30-10(2)3)32-19(16)24-18(25)14-9-12-8-13(23)6-7-15(12)31-20(14)26/h6-10H,5H2,1-4H3,(H,24,25)